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METHYL-(2'R,12'S)-6-(2,12-DIACETOXYTRIDECYL)-2,4-DIHYDROXYBENZOATE
SpectraBase Compound ID 4LwvJwmKvkY
InChI InChI=1S/C25H38O8/c1-17(32-18(2)26)12-10-8-6-5-7-9-11-13-22(33-19(3)27)15-20-14-21(28)16-23(29)24(20)25(30)31-4/h14,16-17,22,28-29H,5-13,15H2,1-4H3/t17-,22-/m0/s1
InChIKey JKWAGNJCIYXQHP-JTSKRJEESA-N
Mol Weight 466.6 g/mol
Molecular Formula C25H38O8
Exact Mass 466.256668 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FFppEl0chtK
Name METHYL-(2'R,12'S)-6-(2,12-DIACETOXYTRIDECYL)-2,4-DIHYDROXYBENZOATE
Compound Number 1B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C25H38O8
InChI InChI=1S/C25H38O8/c1-17(32-18(2)26)12-10-8-6-5-7-9-11-13-22(33-19(3)27)15-20-14-21(28)16-23(29)24(20)25(30)31-4/h14,16-17,22,28-29H,5-13,15H2,1-4H3/t17-,22-/m0/s1
InChIKey JKWAGNJCIYXQHP-JTSKRJEESA-N
Literature Reference Author A.F.BARRERO,J.F.SANCHEZ,F.REYES,I.RODRIGUEZ
Literature Reference Citation PHYTOCHEM.,30,641(1991)
Literature Reference DOI 10.1016/0031-9422(91)83743-5
Molecular Weight 466.572 g/mol
Solvent CDCl3
Source File Reference UWLU32319